sodium 1-oxido-4,6-diphenylpyridin-2-one

C17H12NNaO2 — CID 23704906

IUPACsodium 1-oxido-4,6-diphenylpyridin-2-one
SMILESO=c1cc(-c2ccccc2)cc(-c2ccccc2)n1[O-].[Na+]
InChIInChI=1S/C17H12NO2.Na/c19-17-12-15(13-7-3-1-4-8-13)11-16(18(17)20)14-9-5-2-6-10-14;/h1-12H;/q-1;+1
InChIKeyTUDVVGUIPOXHGU-UHFFFAOYSA-N
MW285.28 g/mol
LogP0.53
Rot. Bonds2

About sodium 1-oxido-4,6-diphenylpyridin-2-one

sodium 1-oxido-4,6-diphenylpyridin-2-one (PubChem CID 23704906) has the molecular formula C17H12NNaO2 and a molecular weight of 285.28 g/mol. Its IUPAC name is sodium 1-oxido-4,6-diphenylpyridin-2-one.

Molecular Properties

Compound Namesodium 1-oxido-4,6-diphenylpyridin-2-one
PubChem CID23704906
Molecular FormulaC17H12NNaO2
Molecular Weight285.28 g/mol
Exact Mass285.08
IUPAC Namesodium 1-oxido-4,6-diphenylpyridin-2-one
SMILESO=c1cc(-c2ccccc2)cc(-c2ccccc2)n1[O-].[Na+]
InChIInChI=1S/C17H12NO2.Na/c19-17-12-15(13-7-3-1-4-8-13)11-16(18(17)20)14-9-5-2-6-10-14;/h1-12H;/q-1;+1
InChIKeyTUDVVGUIPOXHGU-UHFFFAOYSA-N
XLogP0.53
TPSA45.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.28
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N_oxide', 'substructure': 'N/A'}

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Related Compounds

6-Benzyl-1-Hydroxy-4-Methylpyridin-2(1h)-One
CID 13590964
1,2-Dihydro-2-oxo-4,6-diphenyl-3-pyridinecarbonitrile
CID 368861
1-Amino-4,6-diphenylpyridin-2(1H)-one
CID 2776897
2(1H)-Pyridinone, 1-hydroxy-4,6-diphenyl-
CID 4370641
6-phenyl-4-methyl-1-hydroxypyridin-2(1H)-one
CID 13590965
6-Benzyl-1-hydroxypyridin-2-one
CID 71816677
1-Hydroxy-4-methyl-6-[(3-phenylphenyl)methyl]pyridin-2-one
CID 118717085
6-[(3,5-Diphenylphenyl)methyl]-1-hydroxy-4-methylpyridin-2-one
CID 118717092
1-Hydroxy-4-methyl-6-(4-phenylphenyl)pyridin-2-one
CID 132961588
1-Hydroxy-4-methyl-6-[4-(2-methylphenyl)phenyl]pyridin-2-one
CID 132961589
6-[4-(4-Tert-butylphenyl)phenyl]-1-hydroxy-4-methylpyridin-2-one
CID 132961590
1-Hydroxy-4-methyl-6-(3-phenylphenyl)pyridin-2-one
CID 134150090

Frequently Asked Questions

What is the IUPAC name of sodium 1-oxido-4,6-diphenylpyridin-2-one?
The IUPAC name of sodium 1-oxido-4,6-diphenylpyridin-2-one (CID 23704906) is sodium 1-oxido-4,6-diphenylpyridin-2-one.
What is the SMILES notation for sodium 1-oxido-4,6-diphenylpyridin-2-one?
The canonical SMILES for sodium 1-oxido-4,6-diphenylpyridin-2-one is O=c1cc(-c2ccccc2)cc(-c2ccccc2)n1[O-].[Na+].
What is the InChIKey of sodium 1-oxido-4,6-diphenylpyridin-2-one?
The InChIKey is TUDVVGUIPOXHGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12NO2.Na/c19-17-12-15(13-7-3-1-4-8-13)11-16(18(17)20)14-9-5-2-6-10-14;/h1-12H;/q-1;+1.
What are the key properties of sodium 1-oxido-4,6-diphenylpyridin-2-one?
sodium 1-oxido-4,6-diphenylpyridin-2-one has a molecular weight of 285.28 g/mol, XLogP of 0.53, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium 1-oxido-4,6-diphenylpyridin-2-one is sourced from PubChem (CID 23704906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).